SCHEMBL2552096

SCHEMBL2552096

CC(C)C[C@H](C(=O)N1CCN(c2ccc(Cl)cn2)CC1)[C@H](O)C(=O)NO

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 1/20 0.55
▸ MMP2 P08253 1/20 0.55
▸ MMP8 P22894 1/20 0.55
▸ PANK3 Q9H999 5/20 0.51
▸ TRPV1 Q8NER1 3/20 0.43
▸ ME2 P23368 2/20 0.42
▸ ME1 P48163 2/20 0.42
▸ ME3 Q16798 2/20 0.42
▸ DRD2 P14416 4/20 0.41
▸ DRD4 P21917 3/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ NAMPT P43490 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2247600 1.00 MMP1 (0.55) MMP1MMP2MMP8PANK3TRPV1
SCHEMBL2247529 0.89 PANK3 (0.52) PANK3TRPV1ME2ME1ME3
SCHEMBL2549668 0.89 PANK3 (0.52) PANK3TRPV1ME2ME1ME3
SCHEMBL2241911 0.89 MMP1 (0.56) MMP1MMP2MMP8PANK3
SCHEMBL2552328 0.89 MMP1 (0.56) MMP1MMP2MMP8PANK3
SCHEMBL2248888 0.85 MMP1 (0.42) MMP1MMP2MMP8PANK3DRD2
SCHEMBL8271398 0.85 MMP1 (0.42) MMP1MMP2MMP8PANK3DRD2
SCHEMBL11989062 0.85 MMP1 (0.42) MMP1MMP2MMP8PANK3DRD2
SCHEMBL2242116 0.85 MMP1 (0.42) MMP1MMP2MMP8PANK3DRD2
SCHEMBL8273020 0.85 MMP1 (0.42) MMP1MMP2MMP8PANK3DRD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263628-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2011-10-27 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110263628-A1 N-HYDROXYAMIDE DERIVATIVES AND USE THEREOF HNMT, HCAR2, HPGD MMP1 812/4885MMP2 1413/4885MMP8 438/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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